3-[3-(2-methoxyethoxy)propoxymethyl]-N-propylpyridin-2-amine

C15H26N2O3 — CID 103405422

IUPAC3-[3-(2-methoxyethoxy)propoxymethyl]-N-propylpyridin-2-amine
SMILESCCCNc1ncccc1COCCCOCCOC
InChIInChI=1S/C15H26N2O3/c1-3-7-16-15-14(6-4-8-17-15)13-20-10-5-9-19-12-11-18-2/h4,6,8H,3,5,7,9-13H2,1-2H3,(H,16,17)
InChIKeyKFVWPWNOKBLUPW-UHFFFAOYSA-N
MW282.38 g/mol
LogP2.47
Rot. Bonds12

About 3-[3-(2-methoxyethoxy)propoxymethyl]-N-propylpyridin-2-amine

3-[3-(2-methoxyethoxy)propoxymethyl]-N-propylpyridin-2-amine (PubChem CID 103405422) has the molecular formula C15H26N2O3 and a molecular weight of 282.38 g/mol. Its IUPAC name is 3-[3-(2-methoxyethoxy)propoxymethyl]-N-propylpyridin-2-amine.

Molecular Properties

Compound Name3-[3-(2-methoxyethoxy)propoxymethyl]-N-propylpyridin-2-amine
PubChem CID103405422
Molecular FormulaC15H26N2O3
Molecular Weight282.38 g/mol
Exact Mass282.19
IUPAC Name3-[3-(2-methoxyethoxy)propoxymethyl]-N-propylpyridin-2-amine
SMILESCCCNc1ncccc1COCCCOCCOC
InChIInChI=1S/C15H26N2O3/c1-3-7-16-15-14(6-4-8-17-15)13-20-10-5-9-19-12-11-18-2/h4,6,8H,3,5,7,9-13H2,1-2H3,(H,16,17)
InChIKeyKFVWPWNOKBLUPW-UHFFFAOYSA-N
XLogP2.47
TPSA52.61 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds12
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.38
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-[(2-chlorophenyl)methoxymethyl]-N-propylpyridin-2-amine
CID 62465145
3-[(4-chlorophenyl)methoxymethyl]-N-propylpyridin-2-amine
CID 65125822
N-(3-propoxypropyl)-2-(propylamino)pyridine-3-carboxamide
CID 82946727
[2-(3-butoxypropylamino)-3-pyridinyl]methanol
CID 82341843
3-[(4-bromophenoxy)methyl]-N-propylpyridin-2-amine
CID 55075630
N-propyl-3-(2,2,3,3-tetrafluoropropoxymethyl)pyridin-2-amine
CID 55075103
3-(3-methoxypropoxymethyl)pyridin-2-amine
CID 62465864
3-(3,3-dimethylbutoxymethyl)-N-ethylpyridin-2-amine
CID 66224548
N-[[2-[3-(2-methoxyethoxy)propoxy]-3-pyridinyl]methyl]ethanamine
CID 103405698
5-ethyl-6-[3-(2-methoxyethoxy)propoxy]-N-propylpyrimidin-4-amine
CID 103408222
3,5-dichloro-6-[3-(2-methoxyethoxy)propoxy]-N-propylpyridin-2-amine
CID 103408318
2-(3-butoxypropylamino)pyridine-3-carboxylic acid
CID 82341813

Frequently Asked Questions

What is the IUPAC name of 3-[3-(2-methoxyethoxy)propoxymethyl]-N-propylpyridin-2-amine?
The IUPAC name of 3-[3-(2-methoxyethoxy)propoxymethyl]-N-propylpyridin-2-amine (CID 103405422) is 3-[3-(2-methoxyethoxy)propoxymethyl]-N-propylpyridin-2-amine.
What is the SMILES notation for 3-[3-(2-methoxyethoxy)propoxymethyl]-N-propylpyridin-2-amine?
The canonical SMILES for 3-[3-(2-methoxyethoxy)propoxymethyl]-N-propylpyridin-2-amine is CCCNc1ncccc1COCCCOCCOC.
What is the InChIKey of 3-[3-(2-methoxyethoxy)propoxymethyl]-N-propylpyridin-2-amine?
The InChIKey is KFVWPWNOKBLUPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O3/c1-3-7-16-15-14(6-4-8-17-15)13-20-10-5-9-19-12-11-18-2/h4,6,8H,3,5,7,9-13H2,1-2H3,(H,16,17).
What are the key properties of 3-[3-(2-methoxyethoxy)propoxymethyl]-N-propylpyridin-2-amine?
3-[3-(2-methoxyethoxy)propoxymethyl]-N-propylpyridin-2-amine has a molecular weight of 282.38 g/mol, XLogP of 2.47, 12 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(2-methoxyethoxy)propoxymethyl]-N-propylpyridin-2-amine is sourced from PubChem (CID 103405422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).